N-[3-[[(3-azanyl-2,2-dimethyl-propyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-4-nitro-benzamide

Systemtic Name: N-[3-[[(3-azanyl-2,2-dimethyl-propyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-4-nitro-benzamide Openeye Name: N-[3-[[(3-amino-2,2-dimethyl-propyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-nitro-benzamide CAS Name: N-[3-[[(3-amino-2,2-dimethylpropyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[3-[[(3-amino-2,2-dimethylpropyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-nitrobenzamide Traditional Name: N-[3-[[(3-amino-2,2-dimethyl-propyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-nitro-benzamide Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CN(CC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3CC3

Isomeric SMILES

CC(C)(CN)CN(CC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3CC3

InChI

InChI=1S/C23H28N4O4/c1-23(2,14-24)15-26(22(29)18-6-7-18)13-16-4-3-5-19(12-16)25-21(28)17-8-10-20(11-9-17)27(30)31/h3-5,8-12,18H,6-7,13-15,24H2,1-2H3,(H,25,28)